![2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide structure](/static/products/900/900891-53-4.png)
2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
TL;DR: 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide (CAS 900891-53-4) is a chemical compound with molecular formula C15H15ClN8OS and molecular weight 390.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-chloro-2-pyridinyl)acetamide
Also Known As: 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide, 2-[[4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-chloropyridin-2-yl)acetamide, 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-chloropyridin-2-yl)acetamide
| Molecular Formula | C15H15ClN8OS |
|---|---|
| Molecular Weight | 390.08 g/mol |
| LogP | 1.6499 |
| Topological Polar Surface Area | 127.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.07782 |
| Heavy Atoms | 26 |
| Complexity | 951.21466 |
Chemical Identifiers
| CAS Number | 900891-53-4 |
|---|---|
| SMILES | C1CC2=C(C1)NN=C2C3=NN=C(N3N)SCC(=O)NC4=NC=C(C=C4)Cl |
Product Overview
2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide (CAS 900891-53-4), with molecular formula C15H15ClN8OS and molecular weight 390.08 g/mol. IUPAC: 2-[[4-amino-5-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-chloro-2-pyridinyl)acetamide.
Chemical Property Profile of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
Property Insights of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide
The XLogP value of 1.6499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide. The TPSA of 127.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide. Following Lipinski's Rule of Five, 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The CAS number of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is 900891-53-4.
What is the molecular formula of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The molecular formula of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is C15H15ClN8OS.
What is the molecular weight of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
The molecular weight of 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide is 390.08 g/mol.
Where can I buy 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
You can request a quote for 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-amino-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-chloropyridin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.